Training Atomic Cluster Expansion Potentials using LAMMPS and FitSNAP.

Goff, James; Wood, Mitchell; Thompson, Aidan

doi:10.2172/2001842

DOE OSTI · 2001842

Training Atomic Cluster Expansion Potentials using LAMMPS and FitSNAP.

Goff, James·Wood, Mitchell·Thompson, Aidan

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Goff, James, Wood, Mitchell, Thompson, Aidan. 2022-02-01. Training Atomic Cluster Expansion Potentials using LAMMPS and FitSNAP.. https://doi.org/10.2172/2001842

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